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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
3
hits in this display
Target
Platelet-activating factor acetylhydrolase
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50125274
(2-[5-Chloro-2-(4-fluoro-benzylsulfanyl)-4-oxo-4H-p...)
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Affinity Data
IC50: 3nM
Assay Description:
Inhibitory activity against recombinant human Lp-PLA2
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Patents
Similars
In Depth
Details
Article
PubMed
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Target
Cytochrome P450 3A4
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50125274
(2-[5-Chloro-2-(4-fluoro-benzylsulfanyl)-4-oxo-4H-p...)
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Affinity Data
IC50: 2.90E+4nM
Assay Description:
Inhibitory activity against CYP450 3A4 isozyme
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Patents
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Cytochrome P450 2D6
(Homo sapiens (Human))
Glaxosmithkline
Curated by
ChEMBL
Ligand
BDBM50125274
(2-[5-Chloro-2-(4-fluoro-benzylsulfanyl)-4-oxo-4H-p...)
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Copy InChI
Affinity Data
IC50: 8.30E+4nM
Assay Description:
Inhibitory activity against Cytochrome P450 2D6
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Patents
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI